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3-[(3-bromobenzyl)sulfanyl]-5-(2-methoxyphenyl)-1H-1,2,4-triazole
SpectraBase Compound ID EbnyzZ9lQjq
InChI InChI=1S/C16H14BrN3OS/c1-21-14-8-3-2-7-13(14)15-18-16(20-19-15)22-10-11-5-4-6-12(17)9-11/h2-9H,10H2,1H3,(H,18,19,20)
InChIKey JFURBZXOYHBSEG-UHFFFAOYSA-N
Mol Weight 376.27 g/mol
Molecular Formula C16H14BrN3OS
Exact Mass 375.004096 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G5IqBCOao0H
Name 3-[(3-bromobenzyl)sulfanyl]-5-(2-methoxyphenyl)-1H-1,2,4-triazole
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H14BrN3OS/c1-21-14-8-3-2-7-13(14)15-18-16(20-19-15)22-10-11-5-4-6-12(17)9-11/h2-9H,10H2,1H3,(H,18,19,20)
InChIKey JFURBZXOYHBSEG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22320
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D58594; Labnumber: SPLUK-0913; SBI_ID: SBI-022324
Synonyms 2-{3-[(3-bromobenzyl)sulfanyl]-1H-1,2,4-triazol-5-yl}phenyl methyl ether
Temperature 318 °C